1-{2-benzylidene-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl}piperidine-4-carboxamide
Chemical Structure Depiction of
1-{2-benzylidene-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl}piperidine-4-carboxamide
1-{2-benzylidene-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | K788-9753 |
| Compound Name: | 1-{2-benzylidene-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl}piperidine-4-carboxamide |
| Molecular Weight: | 511.64 |
| Molecular Formula: | C30 H29 N3 O3 S |
| Smiles: | Cc1cccc(CN2C(/C(=C/c3ccccc3)Sc3ccc(cc23)C(N2CCC(CC2)C(N)=O)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.6009 |
| logD: | 4.6009 |
| logSw: | -4.4468 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.777 |
| InChI Key: | UQJYDUDFFXWYIR-UHFFFAOYSA-N |